2-[[3-(aminomethyl)phenyl]carbonyl-(1-propanoylpiperidin-4-yl)amino]ethanoic acid

Systemtic Name: 2-[[3-(aminomethyl)phenyl]carbonyl-(1-propanoylpiperidin-4-yl)amino]ethanoic acid Openeye Name: 2-[[3-(aminomethyl)benzoyl]-(1-propanoyl-4-piperidyl)amino]acetic acid CAS Name: 2-[[[3-(aminomethyl)phenyl]-oxomethyl]-[1-(1-oxopropyl)-4-piperidinyl]amino]acetic acid IUPAC Name: 2-[[3-(aminomethyl)benzoyl]-(1-propanoylpiperidin-4-yl)amino]acetic acid Traditional Name: 2-[[3-(aminomethyl)benzoyl]-(1-propionyl-4-piperidyl)amino]acetic acid Formula: C18H25N3O4 MolecularWeight: 347.4088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC(CC1)N(CC(=O)O)C(=O)C2=CC(=CC=C2)CN

Isomeric SMILES

CCC(=O)N1CCC(CC1)N(CC(=O)O)C(=O)C2=CC(=CC=C2)CN

InChI

InChI=1S/C18H25N3O4/c1-2-16(22)20-8-6-15(7-9-20)21(12-17(23)24)18(25)14-5-3-4-13(10-14)11-19/h3-5,10,15H,2,6-9,11-12,19H2,1H3,(H,23,24)