tert-butyl 7-nitro-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole-3-carboxylate

Systemtic Name: tert-butyl 7-nitro-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole-3-carboxylate Openeye Name: tert-butyl 7-nitro-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole-3-carboxylate CAS Name: 7-nitro-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 7-nitro-2,4,5,6-tetrahydro-1H-azepino[4,5-b]indole-3-carboxylate Traditional Name: 7-nitro-2,4,5,6-tetrahydro-1H-azepin[4,5-b]indole-3-carboxylic acid tert-butyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(CC1)NC3=C2C=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(CC1)NC3=C2C=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O4/c1-17(2,3)24-16(21)19-9-7-11-12-5-4-6-14(20(22)23)15(12)18-13(11)8-10-19/h4-6,18H,7-10H2,1-3H3