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ethyl 4-(azepan-1-yl)-3-[(4-ethylphenyl)carbamoylamino]benzoate

ethyl 4-(azepan-1-yl)-3-[(4-ethylphenyl)carbamoylamino]benzoate

Systemtic Name:ethyl 4-(azepan-1-yl)-3-[(4-ethylphenyl)carbamoylamino]benzoate
Openeye Name:ethyl 4-(azepan-1-yl)-3-[(4-ethylphenyl)carbamoylamino]benzoate
CAS Name:4-(1-azepanyl)-3-[[(4-ethylanilino)-oxomethyl]amino]benzoic acid ethyl ester
IUPAC Name:ethyl 4-(azepan-1-yl)-3-[(4-ethylphenyl)carbamoylamino]benzoate
Traditional Name:4-(azepan-1-yl)-3-[(4-ethylphenyl)carbamoylamino]benzoic acid ethyl ester
Formula: C24H31N3O3
MolecularWeight: 409.52124
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCCCCC3


Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCCCCC3


InChI

InChI=1S/C24H31N3O3/c1-3-18-9-12-20(13-10-18)25-24(29)26-21-17-19(23(28)30-4-2)11-14-22(21)27-15-7-5-6-8-16-27/h9-14,17H,3-8,15-16H2,1-2H3,(H2,25,26,29)


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