(4-nitrophenyl) 2-benzamido-5-[bis(azanyl)methylideneamino]pentanoate

Systemtic Name: (4-nitrophenyl) 2-benzamido-5-[bis(azanyl)methylideneamino]pentanoate Openeye Name: (4-nitrophenyl) 2-benzamido-5-guanidino-pentanoate CAS Name: 2-benzamido-5-(diaminomethylideneamino)pentanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 2-benzamido-5-(diaminomethylideneamino)pentanoate Traditional Name: 2-benzamido-5-guanidino-valeric acid (4-nitrophenyl) ester Formula: C19H21N5O5 MolecularWeight: 399.40054

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CCCN=C(N)N)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O5/c20-19(21)22-12-4-7-16(23-17(25)13-5-2-1-3-6-13)18(26)29-15-10-8-14(9-11-15)24(27)28/h1-3,5-6,8-11,16H,4,7,12H2,(H,23,25)(H4,20,21,22)