3-[3-[[4-(aminomethyl)phenyl]methylcarbamoyl]pyridin-2-yl]oxybenzoic acid

Systemtic Name: 3-[3-[[4-(aminomethyl)phenyl]methylcarbamoyl]pyridin-2-yl]oxybenzoic acid Openeye Name: 3-[[3-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-pyridyl]oxy]benzoic acid CAS Name: 3-[[3-[[[4-(aminomethyl)phenyl]methylamino]-oxomethyl]-2-pyridinyl]oxy]benzoic acid IUPAC Name: 3-[3-[[4-(aminomethyl)phenyl]methylcarbamoyl]pyridin-2-yl]oxybenzoic acid Traditional Name: 3-[[3-[[4-(aminomethyl)benzyl]carbamoyl]-2-pyridyl]oxy]benzoic acid Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)CN)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)OC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)CN)C(=O)O

InChI

InChI=1S/C21H19N3O4/c22-12-14-6-8-15(9-7-14)13-24-19(25)18-5-2-10-23-20(18)28-17-4-1-3-16(11-17)21(26)27/h1-11H,12-13,22H2,(H,24,25)(H,26,27)