[4-(azepan-1-ylmethyl)phenyl]-piperazin-1-yl-methanone

Systemtic Name: [4-(azepan-1-ylmethyl)phenyl]-piperazin-1-yl-methanone Openeye Name: [4-(azepan-1-ylmethyl)phenyl]-piperazin-1-yl-methanone CAS Name: [4-(1-azepanylmethyl)phenyl]-(1-piperazinyl)methanone IUPAC Name: [4-(azepan-1-ylmethyl)phenyl]-piperazin-1-ylmethanone Traditional Name: [4-(azepan-1-ylmethyl)phenyl]-piperazino-methanone Formula: C18H27N3O MolecularWeight: 301.42648

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)N3CCNCC3

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(C=C2)C(=O)N3CCNCC3

InChI

InChI=1S/C18H27N3O/c22-18(21-13-9-19-10-14-21)17-7-5-16(6-8-17)15-20-11-3-1-2-4-12-20/h5-8,19H,1-4,9-15H2