2-[[cyclopropyl-[1-(phenylmethyl)piperidin-4-yl]carbamoyl]amino]benzoic acid

Systemtic Name: 2-[[cyclopropyl-[1-(phenylmethyl)piperidin-4-yl]carbamoyl]amino]benzoic acid Openeye Name: 2-[[(1-benzyl-4-piperidyl)-cyclopropyl-carbamoyl]amino]benzoic acid CAS Name: 2-[[[cyclopropyl-[1-(phenylmethyl)-4-piperidinyl]amino]-oxomethyl]amino]benzoic acid IUPAC Name: 2-[[(1-benzylpiperidin-4-yl)-cyclopropylcarbamoyl]amino]benzoic acid Traditional Name: 2-[[(1-benzyl-4-piperidyl)-cyclopropyl-carbamoyl]amino]benzoic acid Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(=O)O

Isomeric SMILES

C1CC1N(C2CCN(CC2)CC3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H27N3O3/c27-22(28)20-8-4-5-9-21(20)24-23(29)26(18-10-11-18)19-12-14-25(15-13-19)16-17-6-2-1-3-7-17/h1-9,18-19H,10-16H2,(H,24,29)(H,27,28)