dimethyl 2-[[1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]amino]butanedioate

Systemtic Name: dimethyl 2-[[1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]amino]butanedioate Openeye Name: dimethyl 2-[[1-[4-(5-phenylpentanoylamino)phenyl]-4-piperidyl]amino]butanedioate CAS Name: 2-[[1-[4-[(1-oxo-5-phenylpentyl)amino]phenyl]-4-piperidinyl]amino]butanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[1-[4-(5-phenylpentanoylamino)phenyl]piperidin-4-yl]amino]butanedioate Traditional Name: 2-[[1-[4-(5-phenylpentanoylamino)phenyl]-4-piperidyl]amino]succinic acid dimethyl ester Formula: C28H37N3O5 MolecularWeight: 495.61048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(=O)OC)NC1CCN(CC1)C2=CC=C(C=C2)NC(=O)CCCCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CC(C(=O)OC)NC1CCN(CC1)C2=CC=C(C=C2)NC(=O)CCCCC3=CC=CC=C3

InChI

InChI=1S/C28H37N3O5/c1-35-27(33)20-25(28(34)36-2)29-23-16-18-31(19-17-23)24-14-12-22(13-15-24)30-26(32)11-7-6-10-21-8-4-3-5-9-21/h3-5,8-9,12-15,23,25,29H,6-7,10-11,16-20H2,1-2H3,(H,30,32)