N-[4-(4-methylpiperazin-1-yl)butyl]chrysen-2-amine

Systemtic Name: N-[4-(4-methylpiperazin-1-yl)butyl]chrysen-2-amine Openeye Name: N-[4-(4-methylpiperazin-1-yl)butyl]chrysen-2-amine CAS Name: N-[4-(4-methyl-1-piperazinyl)butyl]-2-chrysenamine IUPAC Name: N-[4-(4-methylpiperazin-1-yl)butyl]chrysen-2-amine Traditional Name: chrysen-2-yl-[4-(4-methylpiperazino)butyl]amine Formula: C27H31N3 MolecularWeight: 397.55514

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCCNC2=CC3=C(C=C2)C4=C(C=C3)C5=CC=CC=C5C=C4

Isomeric SMILES

CN1CCN(CC1)CCCCNC2=CC3=C(C=C2)C4=C(C=C3)C5=CC=CC=C5C=C4

InChI

InChI=1S/C27H31N3/c1-29-16-18-30(19-17-29)15-5-4-14-28-23-10-13-25-22(20-23)9-12-26-24-7-3-2-6-21(24)8-11-27(25)26/h2-3,6-13,20,28H,4-5,14-19H2,1H3