quinolin-2-yl 2-[2,5-bis(azanyl)pentanoylamino]-3-phenyl-propanoate

Systemtic Name: quinolin-2-yl 2-[2,5-bis(azanyl)pentanoylamino]-3-phenyl-propanoate Openeye Name: 2-quinolyl 2-(2,5-diaminopentanoylamino)-3-phenyl-propanoate CAS Name: 2-[(2,5-diamino-1-oxopentyl)amino]-3-phenylpropanoic acid 2-quinolinyl ester IUPAC Name: quinolin-2-yl 2-(2,5-diaminopentanoylamino)-3-phenylpropanoate Traditional Name: 2-(2,5-diaminopentanoylamino)-3-phenyl-propionic acid 2-quinolyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OC2=NC3=CC=CC=C3C=C2)NC(=O)C(CCCN)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OC2=NC3=CC=CC=C3C=C2)NC(=O)C(CCCN)N

InChI

InChI=1S/C23H26N4O3/c24-14-6-10-18(25)22(28)27-20(15-16-7-2-1-3-8-16)23(29)30-21-13-12-17-9-4-5-11-19(17)26-21/h1-5,7-9,11-13,18,20H,6,10,14-15,24-25H2,(H,27,28)