3-[2-[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]ethanoylamino]-N-ethyl-benzamide

Systemtic Name: 3-[2-[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]ethanoylamino]-N-ethyl-benzamide Openeye Name: 3-[[2-(N-(3-amino-3-oxo-propyl)-4-methoxy-anilino)acetyl]amino]-N-ethyl-benzamide CAS Name: 3-[[2-(N-(3-amino-3-oxopropyl)-4-methoxyanilino)-1-oxoethyl]amino]-N-ethylbenzamide IUPAC Name: 3-[[2-(N-(3-amino-3-oxopropyl)-4-methoxyanilino)acetyl]amino]-N-ethylbenzamide Traditional Name: 3-[[2-(N-(3-amino-3-keto-propyl)-4-methoxy-anilino)acetyl]amino]-N-ethyl-benzamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)CN(CCC(=O)N)C2=CC=C(C=C2)OC

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)CN(CCC(=O)N)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H26N4O4/c1-3-23-21(28)15-5-4-6-16(13-15)24-20(27)14-25(12-11-19(22)26)17-7-9-18(29-2)10-8-17/h4-10,13H,3,11-12,14H2,1-2H3,(H2,22,26)(H,23,28)(H,24,27)