3-[[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]carbamoylamino]-3-naphthalen-1-yl-propanoic acid

Systemtic Name: 3-[[[3-[bis(azanyl)methylideneamino]phenyl]carbonylamino]carbamoylamino]-3-naphthalen-1-yl-propanoic acid Openeye Name: 3-[[(3-guanidinobenzoyl)amino]carbamoylamino]-3-(1-naphthyl)propanoic acid CAS Name: 3-[[[[[3-(diaminomethylideneamino)phenyl]-oxomethyl]hydrazo]-oxomethyl]amino]-3-(1-naphthalenyl)propanoic acid IUPAC Name: 3-[[[3-(diaminomethylideneamino)benzoyl]amino]carbamoylamino]-3-naphthalen-1-ylpropanoic acid Traditional Name: 3-[[(3-guanidinobenzoyl)amino]carbamoylamino]-3-(1-naphthyl)propionic acid Formula: C22H22N6O4 MolecularWeight: 434.44788

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C(CC(=O)O)NC(=O)NNC(=O)C3=CC(=CC=C3)N=C(N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2C(CC(=O)O)NC(=O)NNC(=O)C3=CC(=CC=C3)N=C(N)N

InChI

InChI=1S/C22H22N6O4/c23-21(24)25-15-8-3-7-14(11-15)20(31)27-28-22(32)26-18(12-19(29)30)17-10-4-6-13-5-1-2-9-16(13)17/h1-11,18H,12H2,(H,27,31)(H,29,30)(H4,23,24,25)(H2,26,28,32)