N-[9,10-bis(oxidanylidene)-4-(3-piperidin-1-ylpropanoylamino)anthracen-1-yl]-3-piperidin-1-yl-propanamide hydrochloride

Systemtic Name: N-[9,10-bis(oxidanylidene)-4-(3-piperidin-1-ylpropanoylamino)anthracen-1-yl]-3-piperidin-1-yl-propanamide hydrochloride Openeye Name: N-[9,10-dioxo-4-[3-(1-piperidyl)propanoylamino]-1-anthryl]-3-(1-piperidyl)propanamide hydrochloride CAS Name: N-[9,10-dioxo-4-[[1-oxo-3-(1-piperidinyl)propyl]amino]-1-anthracenyl]-3-(1-piperidinyl)propanamide hydrochloride IUPAC Name: N-[9,10-dioxo-4-(3-piperidin-1-ylpropanoylamino)anthracen-1-yl]-3-piperidin-1-ylpropanamide hydrochloride Traditional Name: N-[9,10-diketo-4-(3-piperidinopropanoylamino)-1-anthryl]-3-piperidino-propionamide hydrochloride Formula: C30H37ClN4O4 MolecularWeight: 553.09218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(=O)NC2=C3C(=C(C=C2)NC(=O)CCN4CCCCC4)C(=O)C5=CC=CC=C5C3=O.Cl

Isomeric SMILES

C1CCN(CC1)CCC(=O)NC2=C3C(=C(C=C2)NC(=O)CCN4CCCCC4)C(=O)C5=CC=CC=C5C3=O.Cl

InChI

InChI=1S/C30H36N4O4.ClH/c35-25(13-19-33-15-5-1-6-16-33)31-23-11-12-24(32-26(36)14-20-34-17-7-2-8-18-34)28-27(23)29(37)21-9-3-4-10-22(21)30(28)38;/h3-4,9-12H,1-2,5-8,13-20H2,(H,31,35)(H,32,36);1H