(phenylmethyl) N-[2,5-bis(azanyl)pentanoyl]-N-(4-nitrophenyl)carbamate

Systemtic Name: (phenylmethyl) N-[2,5-bis(azanyl)pentanoyl]-N-(4-nitrophenyl)carbamate Openeye Name: benzyl N-(2,5-diaminopentanoyl)-N-(4-nitrophenyl)carbamate CAS Name: N-(2,5-diamino-1-oxopentyl)-N-(4-nitrophenyl)carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-(2,5-diaminopentanoyl)-N-(4-nitrophenyl)carbamate Traditional Name: N-(2,5-diaminopentanoyl)-N-(4-nitrophenyl)carbamic acid benzyl ester Formula: C19H22N4O5 MolecularWeight: 386.40178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(CCCN)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N(C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C(CCCN)N

InChI

InChI=1S/C19H22N4O5/c20-12-4-7-17(21)18(24)22(15-8-10-16(11-9-15)23(26)27)19(25)28-13-14-5-2-1-3-6-14/h1-3,5-6,8-11,17H,4,7,12-13,20-21H2