3-[(4-methoxycarbonylphenyl)methyl-pentanoyl-amino]-4-propan-2-yl-benzoic acid

Systemtic Name: 3-[(4-methoxycarbonylphenyl)methyl-pentanoyl-amino]-4-propan-2-yl-benzoic acid Openeye Name: 4-isopropyl-3-[(4-methoxycarbonylphenyl)methyl-pentanoyl-amino]benzoic acid CAS Name: 3-[(4-methoxycarbonylphenyl)methyl-(1-oxopentyl)amino]-4-propan-2-ylbenzoic acid IUPAC Name: 3-[(4-methoxycarbonylphenyl)methyl-pentanoylamino]-4-propan-2-ylbenzoic acid Traditional Name: 3-[(4-carbomethoxybenzyl)-valeryl-amino]-4-isopropyl-benzoic acid Formula: C24H29NO5 MolecularWeight: 411.49076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CC1=CC=C(C=C1)C(=O)OC)C2=C(C=CC(=C2)C(=O)O)C(C)C

Isomeric SMILES

CCCCC(=O)N(CC1=CC=C(C=C1)C(=O)OC)C2=C(C=CC(=C2)C(=O)O)C(C)C

InChI

InChI=1S/C24H29NO5/c1-5-6-7-22(26)25(15-17-8-10-18(11-9-17)24(29)30-4)21-14-19(23(27)28)12-13-20(21)16(2)3/h8-14,16H,5-7,15H2,1-4H3,(H,27,28)