ethyl 4-(4-ethylpiperazin-1-yl)-3-[(3-methoxynaphthalen-2-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[(3-methoxynaphthalen-2-yl)carbonylamino]benzoate Openeye Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[(3-methoxynaphthalene-2-carbonyl)amino]benzoate CAS Name: 4-(4-ethyl-1-piperazinyl)-3-[[(3-methoxy-2-naphthalenyl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(4-ethylpiperazin-1-yl)-3-[(3-methoxynaphthalene-2-carbonyl)amino]benzoate Traditional Name: 4-(4-ethylpiperazino)-3-[(3-methoxy-2-naphthoyl)amino]benzoic acid ethyl ester Formula: C27H31N3O4 MolecularWeight: 461.55274

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC4=CC=CC=C4C=C3OC

Isomeric SMILES

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OCC)NC(=O)C3=CC4=CC=CC=C4C=C3OC

InChI

InChI=1S/C27H31N3O4/c1-4-29-12-14-30(15-13-29)24-11-10-21(27(32)34-5-2)17-23(24)28-26(31)22-16-19-8-6-7-9-20(19)18-25(22)33-3/h6-11,16-18H,4-5,12-15H2,1-3H3,(H,28,31)