[6-methoxy-2-(4-nitrophenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone

Systemtic Name: [6-methoxy-2-(4-nitrophenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone Openeye Name: [6-methoxy-2-(4-nitrophenyl)benzothiophen-3-yl]-[4-[2-(1-piperidyl)ethoxy]phenyl]methanone CAS Name: [6-methoxy-2-(4-nitrophenyl)-1-benzothiophen-3-yl]-[4-[2-(1-piperidinyl)ethoxy]phenyl]methanone IUPAC Name: [6-methoxy-2-(4-nitrophenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone Traditional Name: [6-methoxy-2-(4-nitrophenyl)benzothiophen-3-yl]-[4-(2-piperidinoethoxy)phenyl]methanone Formula: C29H28N2O5S MolecularWeight: 516.60802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C29H28N2O5S/c1-35-24-13-14-25-26(19-24)37-29(21-5-9-22(10-6-21)31(33)34)27(25)28(32)20-7-11-23(12-8-20)36-18-17-30-15-3-2-4-16-30/h5-14,19H,2-4,15-18H2,1H3