3-chloranyl-4-[[3-[(2S)-2-methylpiperidin-1-yl]carbonylphenyl]amino]-1-phenethyl-pyrrole-2,5-dione

Systemtic Name: 3-chloranyl-4-[[3-[(2S)-2-methylpiperidin-1-yl]carbonylphenyl]amino]-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-chloro-4-[3-[(2S)-2-methylpiperidine-1-carbonyl]anilino]-1-phenethyl-pyrrole-2,5-dione CAS Name: 3-chloro-4-[3-[[(2S)-2-methyl-1-piperidinyl]-oxomethyl]anilino]-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-chloro-4-[3-[(2S)-2-methylpiperidine-1-carbonyl]anilino]-1-phenethylpyrrole-2,5-dione Traditional Name: 3-chloro-4-[3-[(2S)-2-methylpiperidine-1-carbonyl]anilino]-1-phenethyl-3-pyrroline-2,5-quinone Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C2=CC(=CC=C2)NC3=C(C(=O)N(C3=O)CCC4=CC=CC=C4)Cl

Isomeric SMILES

C[C@H]1CCCCN1C(=O)C2=CC(=CC=C2)NC3=C(C(=O)N(C3=O)CCC4=CC=CC=C4)Cl

InChI

InChI=1S/C25H26ClN3O3/c1-17-8-5-6-14-28(17)23(30)19-11-7-12-20(16-19)27-22-21(26)24(31)29(25(22)32)15-13-18-9-3-2-4-10-18/h2-4,7,9-12,16-17,27H,5-6,8,13-15H2,1H3/t17-/m0/s1