ethyl 6-nitro-5-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate

Systemtic Name: ethyl 6-nitro-5-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate Openeye Name: ethyl 5-benzyloxy-6-nitro-9H-pyrido[3,4-b]indole-3-carboxylate CAS Name: 6-nitro-5-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-nitro-5-phenylmethoxy-9H-pyrido[3,4-b]indole-3-carboxylate Traditional Name: 5-benzoxy-6-nitro-9H-$b-carboline-3-carboxylic acid ethyl ester Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC=C2C(=C1)C3=C(N2)C=CC(=C3OCC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=NC=C2C(=C1)C3=C(N2)C=CC(=C3OCC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5/c1-2-28-21(25)16-10-14-17(11-22-16)23-15-8-9-18(24(26)27)20(19(14)15)29-12-13-6-4-3-5-7-13/h3-11,23H,2,12H2,1H3