tert-butyl 5-(3-nitrophenyl)-2,4-dihydro-1H-naphtho[1,2-f][2,7]naphthyridine-3-carboxylate

Systemtic Name: tert-butyl 5-(3-nitrophenyl)-2,4-dihydro-1H-naphtho[1,2-f][2,7]naphthyridine-3-carboxylate Openeye Name: tert-butyl 5-(3-nitrophenyl)-2,4-dihydro-1H-naphtho[1,2-f][2,7]naphthyridine-3-carboxylate CAS Name: 5-(3-nitrophenyl)-2,4-dihydro-1H-naphtho[1,2-f][2,7]naphthyridine-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(3-nitrophenyl)-2,4-dihydro-1H-naphtho[1,2-f][2,7]naphthyridine-3-carboxylate Traditional Name: 5-(3-nitrophenyl)-2,4-dihydro-1H-naphtho[1,2-f][2,7]naphthyridine-3-carboxylic acid tert-butyl ester Formula: C27H25N3O4 MolecularWeight: 455.5051

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C3C(=NC(=C2C1)C4=CC(=CC=C4)[N+](=O)[O-])C=CC5=CC=CC=C53

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C3C(=NC(=C2C1)C4=CC(=CC=C4)[N+](=O)[O-])C=CC5=CC=CC=C53

InChI

InChI=1S/C27H25N3O4/c1-27(2,3)34-26(31)29-14-13-21-22(16-29)25(18-8-6-9-19(15-18)30(32)33)28-23-12-11-17-7-4-5-10-20(17)24(21)23/h4-12,15H,13-14,16H2,1-3H3