4-[(4-dimethylaminophenyl)amino]-4-oxidanylidene-2-(pentylamino)butanoic acid

Systemtic Name: 4-[(4-dimethylaminophenyl)amino]-4-oxidanylidene-2-(pentylamino)butanoic acid Openeye Name: 4-[4-(dimethylamino)anilino]-4-oxo-2-(pentylamino)butanoic acid CAS Name: 4-[4-(dimethylamino)anilino]-4-oxo-2-(pentylamino)butanoic acid IUPAC Name: 4-[4-(dimethylamino)anilino]-4-oxo-2-(pentylamino)butanoic acid Traditional Name: 2-(amylamino)-4-[4-(dimethylamino)anilino]-4-keto-butyric acid Formula: C17H27N3O3 MolecularWeight: 321.41458

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(CC(=O)NC1=CC=C(C=C1)N(C)C)C(=O)O

Isomeric SMILES

CCCCCNC(CC(=O)NC1=CC=C(C=C1)N(C)C)C(=O)O

InChI

InChI=1S/C17H27N3O3/c1-4-5-6-11-18-15(17(22)23)12-16(21)19-13-7-9-14(10-8-13)20(2)3/h7-10,15,18H,4-6,11-12H2,1-3H3,(H,19,21)(H,22,23)