methyl 2-[3-(aminomethyl)-2-cyclopentyl-4-[5-(dimethylamino)naphthalen-1-yl]sulfonyl-phenyl]ethanoate

Systemtic Name: methyl 2-[3-(aminomethyl)-2-cyclopentyl-4-[5-(dimethylamino)naphthalen-1-yl]sulfonyl-phenyl]ethanoate Openeye Name: methyl 2-[3-(aminomethyl)-2-cyclopentyl-4-[[5-(dimethylamino)-1-naphthyl]sulfonyl]phenyl]acetate CAS Name: 2-[3-(aminomethyl)-2-cyclopentyl-4-[[5-(dimethylamino)-1-naphthalenyl]sulfonyl]phenyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(aminomethyl)-2-cyclopentyl-4-[5-(dimethylamino)naphthalen-1-yl]sulfonylphenyl]acetate Traditional Name: 2-[3-(aminomethyl)-2-cyclopentyl-4-naphthionyl-phenyl]acetic acid methyl ester Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)C3=C(C(=C(C=C3)CC(=O)OC)C4CCCC4)CN

Isomeric SMILES

CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)C3=C(C(=C(C=C3)CC(=O)OC)C4CCCC4)CN

InChI

InChI=1S/C27H32N2O4S/c1-29(2)23-12-6-11-21-20(23)10-7-13-24(21)34(31,32)25-15-14-19(16-26(30)33-3)27(22(25)17-28)18-8-4-5-9-18/h6-7,10-15,18H,4-5,8-9,16-17,28H2,1-3H3