3-[2-[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]ethanoylamino]-3-phenyl-propanoate

Systemtic Name: 3-[2-[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]ethanoylamino]-3-phenyl-propanoate Openeye Name: 3-[[2-[(3-guanidinobenzoyl)amino]acetyl]amino]-3-phenyl-propanoate CAS Name: 3-[[2-[[[3-(diaminomethylideneamino)phenyl]-oxomethyl]amino]-1-oxoethyl]amino]-3-phenylpropanoate IUPAC Name: 3-[[2-[[3-(diaminomethylideneamino)benzoyl]amino]acetyl]amino]-3-phenylpropanoate Traditional Name: 3-[[2-[(3-guanidinobenzoyl)amino]acetyl]amino]-3-phenyl-propionate Formula: C19H20N5O4- MolecularWeight: 382.3932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)CNC(=O)C2=CC(=CC=C2)N=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)[O-])NC(=O)CNC(=O)C2=CC(=CC=C2)N=C(N)N

InChI

InChI=1S/C19H21N5O4/c20-19(21)23-14-8-4-7-13(9-14)18(28)22-11-16(25)24-15(10-17(26)27)12-5-2-1-3-6-12/h1-9,15H,10-11H2,(H,22,28)(H,24,25)(H,26,27)(H4,20,21,23)/p-1