N-carbamimidoyl-N-methyl-6-[3-(piperidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide

Systemtic Name: N-carbamimidoyl-N-methyl-6-[3-(piperidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide Openeye Name: N-carbamimidoyl-N-methyl-6-[3-(1-piperidylmethyl)phenoxy]-1H-indole-2-carboxamide CAS Name: N-carbamimidoyl-N-methyl-6-[3-(1-piperidinylmethyl)phenoxy]-1H-indole-2-carboxamide IUPAC Name: N-carbamimidoyl-N-methyl-6-[3-(piperidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide Traditional Name: N-amidino-N-methyl-6-[3-(piperidinomethyl)phenoxy]-1H-indole-2-carboxamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CC2=C(N1)C=C(C=C2)OC3=CC=CC(=C3)CN4CCCCC4)C(=N)N

Isomeric SMILES

CN(C(=O)C1=CC2=C(N1)C=C(C=C2)OC3=CC=CC(=C3)CN4CCCCC4)C(=N)N

InChI

InChI=1S/C23H27N5O2/c1-27(23(24)25)22(29)21-13-17-8-9-19(14-20(17)26-21)30-18-7-5-6-16(12-18)15-28-10-3-2-4-11-28/h5-9,12-14,26H,2-4,10-11,15H2,1H3,(H3,24,25)