[(2S)-4-[2,3-bis(azanyl)propyl]-2-butyl-piperazin-1-yl]-naphthalen-1-yl-methanone

Systemtic Name: [(2S)-4-[2,3-bis(azanyl)propyl]-2-butyl-piperazin-1-yl]-naphthalen-1-yl-methanone Openeye Name: [(2S)-2-butyl-4-(2,3-diaminopropyl)piperazin-1-yl]-(1-naphthyl)methanone CAS Name: [(2S)-2-butyl-4-(2,3-diaminopropyl)-1-piperazinyl]-(1-naphthalenyl)methanone IUPAC Name: [(2S)-2-butyl-4-(2,3-diaminopropyl)piperazin-1-yl]-naphthalen-1-ylmethanone Traditional Name: [(2S)-2-butyl-4-(2,3-diaminopropyl)piperazino]-(1-naphthyl)methanone Formula: C22H32N4O MolecularWeight: 368.51568

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CCN1C(=O)C2=CC=CC3=CC=CC=C32)CC(CN)N

Isomeric SMILES

CCCC[C@H]1CN(CCN1C(=O)C2=CC=CC3=CC=CC=C32)CC(CN)N

InChI

InChI=1S/C22H32N4O/c1-2-3-9-19-16-25(15-18(24)14-23)12-13-26(19)22(27)21-11-6-8-17-7-4-5-10-20(17)21/h4-8,10-11,18-19H,2-3,9,12-16,23-24H2,1H3/t18?,19-/m0/s1