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

Systemtic Name: 7-nitro-6-(phenylmethyl)-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one Openeye Name: 6-benzyl-7-nitro-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one CAS Name: 7-nitro-6-(phenylmethyl)-5a,11-dihydro[1]benzopyrano[2,3-b][1,5]benzodiazepin-13-one IUPAC Name: 6-benzyl-7-nitro-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one Traditional Name: 6-benzyl-7-nitro-5a,11-dihydrochromeno[2,3-b][1,5]benzodiazepin-13-one Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3C(=CNC4=C2C(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5O3

Isomeric SMILES

C1=CC=C(C=C1)CN2C3C(=CNC4=C2C(=CC=C4)[N+](=O)[O-])C(=O)C5=CC=CC=C5O3

InChI

InChI=1S/C23H17N3O4/c27-22-16-9-4-5-12-20(16)30-23-17(22)13-24-18-10-6-11-19(26(28)29)21(18)25(23)14-15-7-2-1-3-8-15/h1-13,23-24H,14H2