phenyl 1-[2-[4-(aminomethyl)piperidin-1-yl]ethyl]acridine-9-carboxylate

Systemtic Name: phenyl 1-[2-[4-(aminomethyl)piperidin-1-yl]ethyl]acridine-9-carboxylate Openeye Name: phenyl 1-[2-[4-(aminomethyl)-1-piperidyl]ethyl]acridine-9-carboxylate CAS Name: 1-[2-[4-(aminomethyl)-1-piperidinyl]ethyl]-9-acridinecarboxylic acid phenyl ester IUPAC Name: phenyl 1-[2-[4-(aminomethyl)piperidin-1-yl]ethyl]acridine-9-carboxylate Traditional Name: 1-[2-[4-(aminomethyl)piperidino]ethyl]acridine-9-carboxylic acid phenyl ester Formula: C28H29N3O2 MolecularWeight: 439.54876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN)CCC2=CC=CC3=NC4=CC=CC=C4C(=C32)C(=O)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1CN)CCC2=CC=CC3=NC4=CC=CC=C4C(=C32)C(=O)OC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O2/c29-19-20-13-16-31(17-14-20)18-15-21-7-6-12-25-26(21)27(23-10-4-5-11-24(23)30-25)28(32)33-22-8-2-1-3-9-22/h1-12,20H,13-19,29H2