methyl 3-[(1-aminocarbonylpiperidin-3-yl)carbonylamino]-4-methyl-benzoate

Systemtic Name: methyl 3-[(1-aminocarbonylpiperidin-3-yl)carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(1-carbamoylpiperidine-3-carbonyl)amino]-4-methyl-benzoate CAS Name: 3-[[(1-carbamoyl-3-piperidinyl)-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(1-carbamoylpiperidine-3-carbonyl)amino]-4-methylbenzoate Traditional Name: 3-[(1-carbamoylnipecotoyl)amino]-4-methyl-benzoic acid methyl ester Formula: C16H21N3O4 MolecularWeight: 319.35564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCCN(C2)C(=O)N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C2CCCN(C2)C(=O)N

InChI

InChI=1S/C16H21N3O4/c1-10-5-6-11(15(21)23-2)8-13(10)18-14(20)12-4-3-7-19(9-12)16(17)22/h5-6,8,12H,3-4,7,9H2,1-2H3,(H2,17,22)(H,18,20)