N1,N4-bis[4-(N,N'-diethyl-N-heptanoyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[4-(N,N'-diethyl-N-heptanoyl-carbamimidoyl)phenyl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[4-(N,N'-diethyl-N-heptanoyl-carbamimidoyl)phenyl]terephthalamide CAS Name: N1,N4-bis[4-[ethylimino-[ethyl(1-oxoheptyl)amino]methyl]phenyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[4-(N,N'-diethyl-N-heptanoylcarbamimidoyl)phenyl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[4-(N-enanthyl-N,N'-diethyl-amidino)phenyl]terephthalamide Formula: C44H60N6O4 MolecularWeight: 736.985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N(CC)C(=NCC)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCC)N(CC)C(=O)CCCCCC

Isomeric SMILES

CCCCCCC(=O)N(CC)C(=NCC)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C(=O)NC3=CC=C(C=C3)C(=NCC)N(CC)C(=O)CCCCCC

InChI

InChI=1S/C44H60N6O4/c1-7-13-15-17-19-39(51)49(11-5)41(45-9-3)33-25-29-37(30-26-33)47-43(53)35-21-23-36(24-22-35)44(54)48-38-31-27-34(28-32-38)42(46-10-4)50(12-6)40(52)20-18-16-14-8-2/h21-32H,7-20H2,1-6H3,(H,47,53)(H,48,54)