2-[[2-[(3-methylphenyl)carbamoylamino]-3-oxidanylidene-4-propyl-heptanoyl]amino]ethanoic acid

Systemtic Name: 2-[[2-[(3-methylphenyl)carbamoylamino]-3-oxidanylidene-4-propyl-heptanoyl]amino]ethanoic acid Openeye Name: 2-[[2-(m-tolylcarbamoylamino)-3-oxo-4-propyl-heptanoyl]amino]acetic acid CAS Name: 2-[[2-[[(3-methylanilino)-oxomethyl]amino]-1,3-dioxo-4-propylheptyl]amino]acetic acid IUPAC Name: 2-[[2-[(3-methylphenyl)carbamoylamino]-3-oxo-4-propylheptanoyl]amino]acetic acid Traditional Name: 2-[[3-keto-2-(m-tolylcarbamoylamino)-4-propyl-heptanoyl]amino]acetic acid Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)C(=O)C(C(=O)NCC(=O)O)NC(=O)NC1=CC=CC(=C1)C

Isomeric SMILES

CCCC(CCC)C(=O)C(C(=O)NCC(=O)O)NC(=O)NC1=CC=CC(=C1)C

InChI

InChI=1S/C20H29N3O5/c1-4-7-14(8-5-2)18(26)17(19(27)21-12-16(24)25)23-20(28)22-15-10-6-9-13(3)11-15/h6,9-11,14,17H,4-5,7-8,12H2,1-3H3,(H,21,27)(H,24,25)(H2,22,23,28)