ethyl 3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]propanoate

Systemtic Name: ethyl 3-[(6-chloranylnaphthalen-2-yl)sulfonylamino]-2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]propanoate Openeye Name: ethyl 3-[(6-chloro-2-naphthyl)sulfonylamino]-2-[[1-(4-pyridyl)-4-piperidyl]methylamino]propanoate CAS Name: 3-[(6-chloro-2-naphthalenyl)sulfonylamino]-2-[(1-pyridin-4-yl-4-piperidinyl)methylamino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[(6-chloronaphthalen-2-yl)sulfonylamino]-2-[(1-pyridin-4-ylpiperidin-4-yl)methylamino]propanoate Traditional Name: 3-[(6-chloro-2-naphthyl)sulfonylamino]-2-[[1-(4-pyridyl)-4-piperidyl]methylamino]propionic acid ethyl ester Formula: C26H31ClN4O4S MolecularWeight: 531.06674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Cl)NCC3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

CCOC(=O)C(CNS(=O)(=O)C1=CC2=C(C=C1)C=C(C=C2)Cl)NCC3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C26H31ClN4O4S/c1-2-35-26(32)25(29-17-19-9-13-31(14-10-19)23-7-11-28-12-8-23)18-30-36(33,34)24-6-4-20-15-22(27)5-3-21(20)16-24/h3-8,11-12,15-16,19,25,29-30H,2,9-10,13-14,17-18H2,1H3