N-[9,10-bis(oxidanylidene)-6-(3-piperidin-1-ylpropanoylamino)anthracen-2-yl]-3-piperidin-2-yl-propanamide; iodanylmethane

Systemtic Name: N-[9,10-bis(oxidanylidene)-6-(3-piperidin-1-ylpropanoylamino)anthracen-2-yl]-3-piperidin-2-yl-propanamide; iodanylmethane Openeye Name: N-[9,10-dioxo-6-[3-(1-piperidyl)propanoylamino]-2-anthryl]-3-(2-piperidyl)propanamide; iodomethane CAS Name: N-[9,10-dioxo-6-[[1-oxo-3-(1-piperidinyl)propyl]amino]-2-anthracenyl]-3-(2-piperidinyl)propanamide; iodomethane IUPAC Name: N-[9,10-dioxo-6-(3-piperidin-1-ylpropanoylamino)anthracen-2-yl]-3-piperidin-2-ylpropanamide; iodomethane Traditional Name: N-[9,10-diketo-6-(3-piperidinopropanoylamino)-2-anthryl]-3-(2-piperidyl)propionamide; iodomethane Formula: C31H39IN4O4 MolecularWeight: 658.57023

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Descriptors Computed from Structure

Canonical SMILES:

CI.C1CCN(CC1)CCC(=O)NC2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4)NC(=O)CCC5CCCCN5

Isomeric SMILES

CI.C1CCN(CC1)CCC(=O)NC2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4)NC(=O)CCC5CCCCN5

InChI

InChI=1S/C30H36N4O4.CH3I/c35-27(12-9-20-6-2-3-14-31-20)32-21-7-10-23-25(18-21)29(37)24-11-8-22(19-26(24)30(23)38)33-28(36)13-17-34-15-4-1-5-16-34;1-2/h7-8,10-11,18-20,31H,1-6,9,12-17H2,(H,32,35)(H,33,36);1H3