2-methyl-7-nitro-6-(phenylmethyl)-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one

Systemtic Name: 2-methyl-7-nitro-6-(phenylmethyl)-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one Openeye Name: 6-benzyl-2-methyl-7-nitro-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one CAS Name: 2-methyl-7-nitro-6-(phenylmethyl)-5a,11-dihydro[1]benzopyrano[2,3-b][1,5]benzodiazepin-13-one IUPAC Name: 6-benzyl-2-methyl-7-nitro-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one Traditional Name: 6-benzyl-2-methyl-7-nitro-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one Formula: C24H19N3O4 MolecularWeight: 413.42536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC3C(=CNC4=C(N3CC5=CC=CC=C5)C(=CC=C4)[N+](=O)[O-])C2=O

Isomeric SMILES

CC1=CC2=C(C=C1)OC3C(=CNC4=C(N3CC5=CC=CC=C5)C(=CC=C4)[N+](=O)[O-])C2=O

InChI

InChI=1S/C24H19N3O4/c1-15-10-11-21-17(12-15)23(28)18-13-25-19-8-5-9-20(27(29)30)22(19)26(24(18)31-21)14-16-6-3-2-4-7-16/h2-13,24-25H,14H2,1H3