2-benzamido-3-methyl-butanoic acid; 1-(3-piperidin-1-ylpropyl)indole

Systemtic Name: 2-benzamido-3-methyl-butanoic acid; 1-(3-piperidin-1-ylpropyl)indole Openeye Name: 2-benzamido-3-methyl-butanoic acid; 1-[3-(1-piperidyl)propyl]indole CAS Name: 2-benzamido-3-methylbutanoic acid; 1-[3-(1-piperidinyl)propyl]indole IUPAC Name: 2-benzamido-3-methylbutanoic acid; 1-(3-piperidin-1-ylpropyl)indole Traditional Name: 2-benzamido-3-methyl-butyric acid; 1-(3-piperidinopropyl)indole Formula: C28H37N3O3 MolecularWeight: 463.61168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CC=CC=C1.C1CCN(CC1)CCCN2C=CC3=CC=CC=C32

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CC=CC=C1.C1CCN(CC1)CCCN2C=CC3=CC=CC=C32

InChI

InChI=1S/C16H22N2.C12H15NO3/c1-4-10-17(11-5-1)12-6-13-18-14-9-15-7-2-3-8-16(15)18;1-8(2)10(12(15)16)13-11(14)9-6-4-3-5-7-9/h2-3,7-9,14H,1,4-6,10-13H2;3-8,10H,1-2H3,(H,13,14)(H,15,16)