(3,4,5,6-tetrahydro-2H-azepin-7-ylamino) N-(3-nitrophenyl)carbamate

Systemtic Name: (3,4,5,6-tetrahydro-2H-azepin-7-ylamino) N-(3-nitrophenyl)carbamate Openeye Name: (3,4,5,6-tetrahydro-2H-azepin-7-ylamino) N-(3-nitrophenyl)carbamate CAS Name: N-(3-nitrophenyl)carbamic acid (3,4,5,6-tetrahydro-2H-azepin-7-ylamino) ester IUPAC Name: (3,4,5,6-tetrahydro-2H-azepin-7-ylamino) N-(3-nitrophenyl)carbamate Traditional Name: N-(3-nitrophenyl)carbamic acid (3,4,5,6-tetrahydro-2H-azepin-7-ylamino) ester Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NCC1)NOC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=NCC1)NOC(=O)NC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H16N4O4/c18-13(21-16-12-7-2-1-3-8-14-12)15-10-5-4-6-11(9-10)17(19)20/h4-6,9H,1-3,7-8H2,(H,14,16)(H,15,18)