N-[(3aR,7aS)-2-pyridin-3-yl-3a,7a-dihydro-1,3-benzoxazol-5-yl]-2-methoxy-3-methyl-benzamide

Systemtic Name: N-[(3aR,7aS)-2-pyridin-3-yl-3a,7a-dihydro-1,3-benzoxazol-5-yl]-2-methoxy-3-methyl-benzamide Openeye Name: N-[(3aR,7aS)-2-(3-pyridyl)-3a,7a-dihydro-1,3-benzoxazol-5-yl]-2-methoxy-3-methyl-benzamide CAS Name: N-[(3aR,7aS)-2-(3-pyridinyl)-3a,7a-dihydro-1,3-benzoxazol-5-yl]-2-methoxy-3-methylbenzamide IUPAC Name: N-[(3aR,7aS)-2-pyridin-3-yl-3a,7a-dihydro-1,3-benzoxazol-5-yl]-2-methoxy-3-methylbenzamide Traditional Name: N-[(3aR,7aS)-2-(3-pyridyl)-3a,7a-dihydro-1,3-benzoxazol-5-yl]-2-methoxy-3-methyl-benzamide Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC2=CC3C(C=C2)OC(=N3)C4=CN=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC2=C[C@@H]3[C@H](C=C2)OC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C21H19N3O3/c1-13-5-3-7-16(19(13)26-2)20(25)23-15-8-9-18-17(11-15)24-21(27-18)14-6-4-10-22-12-14/h3-12,17-18H,1-2H3,(H,23,25)/t17-,18+/m1/s1