(2R)-5-[bis(azanyl)methylideneazaniumyl]-2-(diphenylcarbamoylamino)pentanoate

Systemtic Name: (2R)-5-[bis(azanyl)methylideneazaniumyl]-2-(diphenylcarbamoylamino)pentanoate Openeye Name: (2R)-5-(diaminomethyleneammonio)-2-(diphenylcarbamoylamino)pentanoate CAS Name: (2R)-5-(diaminomethylideneammonio)-2-[[oxo-(N-phenylanilino)methyl]amino]pentanoate IUPAC Name: (2R)-5-(diaminomethylideneazaniumyl)-2-(diphenylcarbamoylamino)pentanoate Traditional Name: (2R)-5-(diaminomethyleneammonio)-2-(diphenylcarbamoylamino)valerate Formula: C19H23N5O3 MolecularWeight: 369.41762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)NC(CCC[NH+]=C(N)N)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(C2=CC=CC=C2)C(=O)N[C@H](CCC[NH+]=C(N)N)C(=O)[O-]

InChI

InChI=1S/C19H23N5O3/c20-18(21)22-13-7-12-16(17(25)26)23-19(27)24(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-6,8-11,16H,7,12-13H2,(H,23,27)(H,25,26)(H4,20,21,22)/t16-/m1/s1