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2-[4-(4-aminophenyl)butyl-(3-cyanophenyl)amino]ethanoic acid

2-[4-(4-aminophenyl)butyl-(3-cyanophenyl)amino]ethanoic acid

Systemtic Name:2-[4-(4-aminophenyl)butyl-(3-cyanophenyl)amino]ethanoic acid
Openeye Name:2-[N-[4-(4-aminophenyl)butyl]-3-cyano-anilino]acetic acid
CAS Name:2-[N-[4-(4-aminophenyl)butyl]-3-cyanoanilino]acetic acid
IUPAC Name:2-[N-[4-(4-aminophenyl)butyl]-3-cyanoanilino]acetic acid
Traditional Name:2-[N-[4-(4-aminophenyl)butyl]-3-cyano-anilino]acetic acid
Formula: C19H21N3O2
MolecularWeight: 323.38894
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(CCCCC2=CC=C(C=C2)N)CC(=O)O)C#N


Isomeric SMILES

C1=CC(=CC(=C1)N(CCCCC2=CC=C(C=C2)N)CC(=O)O)C#N


InChI

InChI=1S/C19H21N3O2/c20-13-16-5-3-6-18(12-16)22(14-19(23)24)11-2-1-4-15-7-9-17(21)10-8-15/h3,5-10,12H,1-2,4,11,14,21H2,(H,23,24)


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