N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide

Systemtic Name: N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Openeye Name: N-[[4-(3-methyl-1-piperidyl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide CAS Name: N-[[4-(3-methyl-1-piperidinyl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide IUPAC Name: N-[[4-(3-methylpiperidin-1-yl)phenyl]methyl]-4-methylsulfonyl-2,3-dihydro-1,4-benzoxazine-2-carboxamide Traditional Name: 4-mesyl-N-[4-(3-methylpiperidino)benzyl]-2,3-dihydro-1,4-benzoxazine-2-carboxamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C

Isomeric SMILES

CC1CCCN(C1)C2=CC=C(C=C2)CNC(=O)C3CN(C4=CC=CC=C4O3)S(=O)(=O)C

InChI

InChI=1S/C23H29N3O4S/c1-17-6-5-13-25(15-17)19-11-9-18(10-12-19)14-24-23(27)22-16-26(31(2,28)29)20-7-3-4-8-21(20)30-22/h3-4,7-12,17,22H,5-6,13-16H2,1-2H3,(H,24,27)