6-azanylidene-N,N-dibutyl-9-[3-(piperidin-1-ylmethyl)phenyl]xanthen-3-amine

Systemtic Name: 6-azanylidene-N,N-dibutyl-9-[3-(piperidin-1-ylmethyl)phenyl]xanthen-3-amine Openeye Name: N,N-dibutyl-6-imino-9-[3-(1-piperidylmethyl)phenyl]xanthen-3-amine CAS Name: N,N-dibutyl-6-imino-9-[3-(1-piperidinylmethyl)phenyl]-3-xanthenamine IUPAC Name: N,N-dibutyl-6-imino-9-[3-(piperidin-1-ylmethyl)phenyl]xanthen-3-amine Traditional Name: dibutyl-[6-imino-9-[3-(piperidinomethyl)phenyl]xanthen-3-yl]amine Formula: C33H41N3O MolecularWeight: 495.69814

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC2=C(C=C1)C(=C3C=CC(=N)C=C3O2)C4=CC(=CC=C4)CN5CCCCC5

Isomeric SMILES

CCCCN(CCCC)C1=CC2=C(C=C1)C(=C3C=CC(=N)C=C3O2)C4=CC(=CC=C4)CN5CCCCC5

InChI

InChI=1S/C33H41N3O/c1-3-5-19-36(20-6-4-2)28-14-16-30-32(23-28)37-31-22-27(34)13-15-29(31)33(30)26-12-10-11-25(21-26)24-35-17-8-7-9-18-35/h10-16,21-23,34H,3-9,17-20,24H2,1-2H3