(2S,4aS,7R,8aR)-4,4,7-trimethyl-2-(phenylselanylmethyl)-3-prop-2-enyl-4a,5,6,7,8,8a-hexahydro-2H-benzo[e][1,3]oxazine

Systemtic Name: (2S,4aS,7R,8aR)-4,4,7-trimethyl-2-(phenylselanylmethyl)-3-prop-2-enyl-4a,5,6,7,8,8a-hexahydro-2H-benzo[e][1,3]oxazine Openeye Name: (2S,4aS,7R,8aR)-3-allyl-4,4,7-trimethyl-2-(phenylselanylmethyl)-4a,5,6,7,8,8a-hexahydro-2H-benzo[e][1,3]oxazine CAS Name: (2S,4aS,7R,8aR)-4,4,7-trimethyl-2-[(phenylseleno)methyl]-3-prop-2-enyl-4a,5,6,7,8,8a-hexahydro-2H-benzo[e][1,3]oxazine IUPAC Name: (2S,4aS,7R,8aR)-4,4,7-trimethyl-2-(phenylselanylmethyl)-3-prop-2-enyl-4a,5,6,7,8,8a-hexahydro-2H-benzo[e][1,3]oxazine Traditional Name: (2S,4aS,7R,8aR)-3-allyl-4,4,7-trimethyl-2-[(phenylseleno)methyl]-4a,5,6,7,8,8a-hexahydro-2H-benzo[e][1,3]oxazine Formula: C21H31NOSe MolecularWeight: 392.43694

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2C(C1)OC(N(C2(C)C)CC=C)C[Se]C3=CC=CC=C3

Isomeric SMILES

C[C@@H]1CC[C@@H]2[C@@H](C1)O[C@H](N(C2(C)C)CC=C)C[Se]C3=CC=CC=C3

InChI

InChI=1S/C21H31NOSe/c1-5-13-22-20(15-24-17-9-7-6-8-10-17)23-19-14-16(2)11-12-18(19)21(22,3)4/h5-10,16,18-20H,1,11-15H2,2-4H3/t16-,18-,19-,20+/m1/s1