(6aS)-8-ethyl-2-methoxy-8-oxidanyl-3-phenylmethoxy-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one

Systemtic Name: (6aS)-8-ethyl-2-methoxy-8-oxidanyl-3-phenylmethoxy-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one Openeye Name: (6aS)-3-benzyloxy-8-ethyl-8-hydroxy-2-methoxy-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one CAS Name: (6aS)-8-ethyl-8-hydroxy-2-methoxy-3-phenylmethoxy-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one IUPAC Name: (6aS)-8-ethyl-8-hydroxy-2-methoxy-3-phenylmethoxy-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one Traditional Name: (6aS)-3-benzoxy-8-ethyl-8-hydroxy-2-methoxy-7,9-dihydro-6aH-pyrrolo[2,1-c][1,4]benzodiazepin-11-one Formula: C22H24N2O4 MolecularWeight: 380.43696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2C=NC3=CC(=C(C=C3C(=O)N2C1)OC)OCC4=CC=CC=C4)O

Isomeric SMILES

CCC1(C[C@H]2C=NC3=CC(=C(C=C3C(=O)N2C1)OC)OCC4=CC=CC=C4)O

InChI

InChI=1S/C22H24N2O4/c1-3-22(26)11-16-12-23-18-10-20(28-13-15-7-5-4-6-8-15)19(27-2)9-17(18)21(25)24(16)14-22/h4-10,12,16,26H,3,11,13-14H2,1-2H3/t16-,22?/m0/s1