ethyl (E)-4-[(3aS,4S,7S,7aR)-2,2-dimethyl-7-[(E)-3-pyridin-2-ylprop-2-enyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]-3-methyl-but-2-enoate

Systemtic Name: ethyl (E)-4-[(3aS,4S,7S,7aR)-2,2-dimethyl-7-[(E)-3-pyridin-2-ylprop-2-enyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]-3-methyl-but-2-enoate Openeye Name: ethyl (E)-4-[(3aS,4S,7S,7aR)-2,2-dimethyl-7-[(E)-3-(2-pyridyl)allyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]-3-methyl-but-2-enoate CAS Name: (E)-4-[(3aS,4S,7S,7aR)-2,2-dimethyl-7-[(E)-3-(2-pyridinyl)prop-2-enyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]-3-methyl-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-4-[(3aS,4S,7S,7aR)-2,2-dimethyl-7-[(E)-3-pyridin-2-ylprop-2-enyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]-3-methylbut-2-enoate Traditional Name: (E)-4-[(3aS,4S,7S,7aR)-2,2-dimethyl-7-[(E)-3-(2-pyridyl)allyl]-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-4-yl]-3-methyl-but-2-enoic acid ethyl ester Formula: C23H31NO5 MolecularWeight: 401.49594

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=C(C)CC1C2C(C(CO1)CC=CC3=CC=CC=N3)OC(O2)(C)C

Isomeric SMILES

CCOC(=O)/C=C(\C)/C[C@H]1[C@H]2[C@@H]([C@H](CO1)C/C=C/C3=CC=CC=N3)OC(O2)(C)C

InChI

InChI=1S/C23H31NO5/c1-5-26-20(25)14-16(2)13-19-22-21(28-23(3,4)29-22)17(15-27-19)9-8-11-18-10-6-7-12-24-18/h6-8,10-12,14,17,19,21-22H,5,9,13,15H2,1-4H3/b11-8+,16-14+/t17-,19-,21+,22-/m0/s1