(4S)-4-benzamido-5-[4-[bis(azanyl)methylideneamino]phenoxy]-5-oxidanylidene-pentanoic acid

Systemtic Name: (4S)-4-benzamido-5-[4-[bis(azanyl)methylideneamino]phenoxy]-5-oxidanylidene-pentanoic acid Openeye Name: (4S)-4-benzamido-5-(4-guanidinophenoxy)-5-oxo-pentanoic acid CAS Name: (4S)-4-benzamido-5-[4-(diaminomethylideneamino)phenoxy]-5-oxopentanoic acid IUPAC Name: (4S)-4-benzamido-5-[4-(diaminomethylideneamino)phenoxy]-5-oxopentanoic acid Traditional Name: (4S)-4-benzamido-5-(4-guanidinophenoxy)-5-keto-valeric acid Formula: C19H20N4O5 MolecularWeight: 384.3859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CCC(=O)O)C(=O)OC2=CC=C(C=C2)N=C(N)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)OC2=CC=C(C=C2)N=C(N)N

InChI

InChI=1S/C19H20N4O5/c20-19(21)22-13-6-8-14(9-7-13)28-18(27)15(10-11-16(24)25)23-17(26)12-4-2-1-3-5-12/h1-9,15H,10-11H2,(H,23,26)(H,24,25)(H4,20,21,22)/t15-/m0/s1