4-[5-(4-carbamimidoylphenoxy)pentoxy]-3-methoxy-N,N-di(propan-2-yl)benzamide; 2-oxidanylethanesulfonic acid

Systemtic Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]-3-methoxy-N,N-di(propan-2-yl)benzamide; 2-oxidanylethanesulfonic acid Openeye Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]-N,N-diisopropyl-3-methoxy-benzamide; 2-hydroxyethanesulfonic acid CAS Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]-3-methoxy-N,N-di(propan-2-yl)benzamide; 2-hydroxyethanesulfonic acid IUPAC Name: 4-[5-(4-carbamimidoylphenoxy)pentoxy]-3-methoxy-N,N-di(propan-2-yl)benzamide; 2-hydroxyethanesulfonic acid Traditional Name: 4-[5-(4-amidinophenoxy)pentoxy]-N,N-diisopropyl-3-methoxy-benzamide; 2-hydroxyethanesulfonic acid Formula: C28H43N3O8S MolecularWeight: 581.72132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C1=CC(=C(C=C1)OCCCCCOC2=CC=C(C=C2)C(=N)N)OC.C(CS(=O)(=O)O)O

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C1=CC(=C(C=C1)OCCCCCOC2=CC=C(C=C2)C(=N)N)OC.C(CS(=O)(=O)O)O

InChI

InChI=1S/C26H37N3O4.C2H6O4S/c1-18(2)29(19(3)4)26(30)21-11-14-23(24(17-21)31-5)33-16-8-6-7-15-32-22-12-9-20(10-13-22)25(27)28;3-1-2-7(4,5)6/h9-14,17-19H,6-8,15-16H2,1-5H3,(H3,27,28);3H,1-2H2,(H,4,5,6)