methyl N-[4-[4-[(2-methylcyclohexa-1,5-dien-3-yn-1-yl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate

Systemtic Name: methyl N-[4-[4-[(2-methylcyclohexa-1,5-dien-3-yn-1-yl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate Openeye Name: methyl N-[4-[[4-[(2-methylcyclohexa-1,5-dien-3-yn-1-yl)carbamoyl]-1-piperidyl]sulfonyl]phenyl]carbamate CAS Name: N-[4-[[4-[[(2-methyl-1-cyclohexa-1,5-dien-3-ynyl)amino]-oxomethyl]-1-piperidinyl]sulfonyl]phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[4-[4-[(2-methylcyclohexa-1,5-dien-3-yn-1-yl)carbamoyl]piperidin-1-yl]sulfonylphenyl]carbamate Traditional Name: N-[4-[4-[(2-methylcyclohexa-1,5-dien-3-yn-1-yl)carbamoyl]piperidino]sulfonylphenyl]carbamic acid methyl ester Formula: C21H23N3O5S MolecularWeight: 429.48942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC#C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)OC

Isomeric SMILES

CC1=C(C=CC#C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)OC

InChI

InChI=1S/C21H23N3O5S/c1-15-5-3-4-6-19(15)23-20(25)16-11-13-24(14-12-16)30(27,28)18-9-7-17(8-10-18)22-21(26)29-2/h4,6-10,16H,11-14H2,1-2H3,(H,22,26)(H,23,25)