ethyl 4-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[4-(1-naphthylmethyl)piperazin-1-yl]acetyl]amino]benzoate CAS Name: 4-[[2-[4-(1-naphthalenylmethyl)-1-piperazinyl]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-(1-naphthylmethyl)piperazino]acetyl]amino]benzoic acid ethyl ester Formula: C26H29N3O3 MolecularWeight: 431.52676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H29N3O3/c1-2-32-26(31)21-10-12-23(13-11-21)27-25(30)19-29-16-14-28(15-17-29)18-22-8-5-7-20-6-3-4-9-24(20)22/h3-13H,2,14-19H2,1H3,(H,27,30)